1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(2-methyl-1-phenylazanyl-propan-2-yl)urea

Systemtic Name: 1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(2-methyl-1-phenylazanyl-propan-2-yl)urea Openeye Name: 1-(2-anilino-1,1-dimethyl-ethyl)-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]urea CAS Name: 1-(1-anilino-2-methylpropan-2-yl)-3-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylphenyl]urea IUPAC Name: 1-(1-anilino-2-methylpropan-2-yl)-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]urea Traditional Name: 1-(2-anilino-1,1-dimethyl-ethyl)-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]urea Formula: C31H35N5O2 MolecularWeight: 509.6419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NC(C)(C)CNC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NC(C)(C)CNC4=CC=CC=C4

InChI

InChI=1S/C31H35N5O2/c1-22-9-12-26(29(37)36-17-15-25(16-18-36)24-13-10-23(20-32)11-14-24)19-28(22)34-30(38)35-31(2,3)21-33-27-7-5-4-6-8-27/h4-14,19,25,33H,15-18,21H2,1-3H3,(H2,34,35,38)